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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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9576 91145 1 O3C10H18 A3B10C18 -133.6 3.4 -10.31 0.36 0
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9577 91146 1 SO3N4C10H14 AB3C4D10E14 -19.66 11.16 -9.15 -1.06 0
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9578 91150 1 C13H22 A13B22 -4.73 1.58 -9.03 1.27 0
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9579 91151 1 O2C15H26 A2B15C26 -146.5 2.34 -10.24 0.96 0
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9580 91189 1 N2O3H22C24 A2B3C22D24 -47.96 4.93 -8.23 -0.62 0
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9581 91192 1 SN3O4C13H15 AB3C4D13E15 -57.17 6.48 -9.94 -1.03 0
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9582 91222 1 S2N3C12H15 A2B3C12D15 69.25 3.27 -9.33 -0.44 0
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9583 91223 1 SN2C11H14 AB2C11D14 37.32 3.33 -9.1 -0.23 0
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9584 91224 3 C5H8 A5B8 -0.32 1.41 -8.3 1.2 0
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9585 91225 1 S2N4O8H20C23 A2B4C8D20E23 -189.31 14.82 -9.1 -2.05 0
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9586 91233 1 N2O5C17H24 A2B5C17D24 -226.57 3.12 -9.81 -0.22 0
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9587 91262 1 N5H28C30 A5B28C30 145.72 4.17 0.0 0.0 1
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9588 91263 1 O7C26H36 A7B26C36 -336.66 7.93 -9.59 -0.23 0
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9589 91264 1 Cl3H9C10 A3B9C10 5.16 2.35 -9.56 -0.3 0
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9590 91266 1 NBr2C4H5 AB2C4D5 19.4 3.92 -11.06 -1.6 0
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9591 91274 1 ClNO2S2C20H26 ABC2D2E20F26 -83.1 6.07 -8.78 -0.3 0
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9592 91276 1 N2O3C17H26 A2B3C17D26 -123.69 4.3 -8.74 0.29 0
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9593 91278 1 ON3C19H19 AB3C19D19 56.93 6.32 -8.25 -1.08 0
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9594 91281 1 NO2C8H13 AB2C8D13 -113.77 3.85 -10.3 0.09 0
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9595 91282 1 NOC13H13 ABC13D13 1.71 3.87 -9.99 -0.22 0
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9596 91286 2 NSO3C10H10 ABC3D10E10 -210.25 8.48 -9.03 -0.88 0
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9597 91296 1 Cl2N2C7H12 A2B2C7D12 -47.54 6.17 -8.96 -0.08 0
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9598 91299 1 O2N3C10H17 A2B3C10D17 -50.64 5.14 -9.46 -0.29 0
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9599 91346 1 NO4C10H13 AB4C10D13 -151.97 5.19 -9.44 -0.48 0
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9600 91360 3 NOC4H9 ABC4D9 -149.6 3.84 -8.88 1.79 0
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9601 91361 2 OC9H18 AB9C18 -172.07 2.09 -10.78 0.88 0
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9602 91403 1 ClO2N3C5H8 AB2C3D5E8 -14.84 6.76 -9.99 -1.06 0
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9603 91407 1 NBr2O2C14H21 AB2C2D14E21 -65.19 3.36 -8.69 -0.42 0
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9604 91425 2 OC8H16 AB8C16 -163.2 5.06 -10.73 0.74 0
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9605 91434 1 NO6C14H17 AB6C14D17 -215.26 5.34 -10.18 -0.54 0
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9606 91477 1 OC27H44 AB27C44 -111.13 5.71 -9.71 0.09 0
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9607 91486 1 NO2C18H39 AB2C18D39 -174.41 3.6 -9.48 2.36 0
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9608 91487 1 Cl2H2O3C4 A2B2C3D4 -114.34 3.15 -10.46 -1.63 0
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9609 91489 2 OC2N2H3 AB2C2D3 -32.1 3.53 -9.99 -0.85 0
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9610 91514 1 NO3C10H11 AB3C10D11 -110.8 6.73 -10.19 -0.77 0
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9611 91544 1 NOC24H39 ABC24D39 -81.47 3.68 -8.82 0.12 0
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9612 91548 1 BrClC2H2O2 ABC2D2E2 -85.68 2.99 -11.27 -1.72 0
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9613 91556 1 O4C25H30 A4B25C30 -85.41 4.28 -8.27 -1.02 0
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9614 91558 1 ClN2O2C20H25 AB2C2D20E25 -58.33 2.38 -9.01 -0.94 0
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9615 91563 1 O2C3H6 A2B3C6 -71.01 3.3 -10.32 0.18 0
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9616 91564 1 ClBr2C4H7 AB2C4D7 -30.05 2.0 -10.52 -0.86 0
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9617 91570 1 MnZnN4C8S8H12 ABC4D8E8F12 176.54 4.52 0.0 0.0 0
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9618 91576 1 O6C7H14 A6B7C14 -275.51 1.54 -10.5 1.04 0
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9619 91578 1 S5N6O16C24H48 A5B6C16D24E48 -682.62 4.96 -7.64 -1.29 0
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9620 91627 1 ClNO3C14H18 ABC3D14E18 -133.41 6.45 -9.94 -0.5 0
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9621 91631 2 H2Cl3C6 A2B3C6 2.17 0.82 -9.82 -1.25 0
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9622 91633 1 H3Cl7C12 A3B7C12 -4.2 1.14 -9.7 -1.24 0
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9623 91639 4 O6C11H16 A6B11C16 -1019.59 2.4 -9.38 -1.09 0
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9624 91667 1 BrF2O7C25H29 AB2C7D25E29 -384.77 6.97 -10.14 -0.98 0
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9625 91707 1 ClNO5H16C18 ABC5D16E18 -129.54 3.05 -9.23 -0.78 0